2-Methyl-1,3-benzodioxole-2-ethanamine
TL;DR: 2-Methyl-1,3-benzodioxole-2-ethanamine (CAS 730912-57-9) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-methyl-1,3-benzodioxol-2-yl)ethanamine
Also Known As: 2-Methyl-1,3-benzodioxole-2-ethanamine, 2-(2-methyl-1,3-benzodioxol-2-yl)ethanamine, 2-(2-methylbenzo[1,3]dioxol-2-yl)ethanamine, 2-(2-Methyl-2H-1,3-benzodioxol-2-yl)ethan-1-amine
Technical Specifications
| Molecular Formula | C10H13NO2 |
| Molecular Weight | 179.09464 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 44.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 179.09464 Da |
| Heavy Atoms | 13 |
| Complexity | 170.0 |
| SMILES | CC1(OC2=CC=CC=C2O1)CCN |
| InChIKey | QJVISIGJNWISTB-UHFFFAOYSA-N |
Chemical Property Profile of 2-Methyl-1,3-benzodioxole-2-ethanamine
Property Insights of 2-Methyl-1,3-benzodioxole-2-ethanamine
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-1,3-benzodioxole-2-ethanamine. With a topological polar surface area (TPSA) of 44.5 Ų, 2-Methyl-1,3-benzodioxole-2-ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-1,3-benzodioxole-2-ethanamine has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Methyl-1,3-benzodioxole-2-ethanamine?
The CAS number of 2-Methyl-1,3-benzodioxole-2-ethanamine is 730912-57-9.
What is the molecular formula of 2-Methyl-1,3-benzodioxole-2-ethanamine?
The molecular formula of 2-Methyl-1,3-benzodioxole-2-ethanamine is C10H13NO2.
What is the molecular weight of 2-Methyl-1,3-benzodioxole-2-ethanamine?
The molecular weight of 2-Methyl-1,3-benzodioxole-2-ethanamine is 179.09464 g/mol.
Where can I buy 2-Methyl-1,3-benzodioxole-2-ethanamine?
You can request a quote for 2-Methyl-1,3-benzodioxole-2-ethanamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methyl-1,3-benzodioxole-2-ethanamine?
Yes, CoreyChem provides custom synthesis services for 2-Methyl-1,3-benzodioxole-2-ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.